4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one

C10H15N3O — CID 136957357

IUPAC4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one
SMILESCC1CCN(c2cc(=O)[nH]cn2)CC1
InChIInChI=1S/C10H15N3O/c1-8-2-4-13(5-3-8)9-6-10(14)12-7-11-9/h6-8H,2-5H2,1H3,(H,11,12,14)
InChIKeyVMAQHXRFKXWGMR-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.01
Rot. Bonds1

About 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one

4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one (PubChem CID 136957357) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one
PubChem CID136957357
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one
SMILESCC1CCN(c2cc(=O)[nH]cn2)CC1
InChIInChI=1S/C10H15N3O/c1-8-2-4-13(5-3-8)9-6-10(14)12-7-11-9/h6-8H,2-5H2,1H3,(H,11,12,14)
InChIKeyVMAQHXRFKXWGMR-UHFFFAOYSA-N
XLogP1.01
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(Piperidin-1-yl)-3,4-dihydropyrimidin-4-one
CID 136957380
4-[3-(trifluoromethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 136487742
3-methyl-6-(4-(trifluoromethyl)piperidin-1-yl)pyrimidin-4(3H)-one
CID 132451116
4-[4-(trifluoromethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 136957965
6-(4,4-Difluoropiperidin-1-yl)pyrimidin-4(3H)-one
CID 146673525
6-(4-Fluoropiperidin-1-yl)-3,4-dihydropyrimidin-4-one
CID 164648869
N-{[4-fluoro-1-(1-methyl-6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-4-yl]methyl}acetamide
CID 165431804
6-[3-(Fluoromethyl)piperidin-1-yl]-3-methyl-3,4-dihydropyrimidin-4-one
CID 172881015
N-{[4-fluoro-1-(1-methyl-6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-4-yl]methyl}cyclopropanecarboxamide
CID 175648121
6-amino-2-(4-methylpiperidin-1-yl)pyrimidin-4(3H)-one
CID 135638182
6-Amino-2-(3-methyl-1-piperidinyl)-4(3H)-pyrimidinone
CID 135646473
4-(4-piperidin-4-ylpiperidin-1-yl)-1H-pyrimidin-6-one
CID 136205542

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one?
The IUPAC name of 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one (CID 136957357) is 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one?
The canonical SMILES for 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one is CC1CCN(c2cc(=O)[nH]cn2)CC1.
What is the InChIKey of 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one?
The InChIKey is VMAQHXRFKXWGMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-8-2-4-13(5-3-8)9-6-10(14)12-7-11-9/h6-8H,2-5H2,1H3,(H,11,12,14).
What are the key properties of 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one?
4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one has a molecular weight of 193.25 g/mol, XLogP of 1.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpiperidin-1-yl)-1H-pyrimidin-6-one is sourced from PubChem (CID 136957357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).